A dimolybdenum tetraacetate (Mo(OCCH)) molecule is embedded between two electrodes formed by semi-infinite 1D monatomic chains of lithium, aluminum, and titanium atoms. Electron transport through the Mo(OCCH) molecule is calculated. The role of quadrupole bonding in the transport properties of the studied systems is analyzed.
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| http://www.ncbi.nlm.nih.gov/pmc/articles/PMC9609368 | PMC |
| http://dx.doi.org/10.3390/molecules27206912 | DOI Listing |
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